| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43 | Very low | 51.1 | Low | 234 Ų | 234 | 153.1 Ų | 153.1 | 100% | 1.153 | 85% | 0.851 | S | S | * | * | 0 | 122.3 | 0 | -125.4 | 96.6 | 149.8 | 0 | 0 | 106.6 | |||||
| 2 | N | 49.5 | Very low | 50.7 | Low | 158 Ų | 158 | 155.5 Ų | 155.5 | 85% | 0.845 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -80 | 141.7 | -165.2 | -59.2 | -26.8 | 0 | 0 | 0 | 111.5 | ||
| 3 | H | 60.5 | Low | 50.1 | Low | 189 Ų | 189 | 153.5 Ų | 153.5 | 88% | 0.875 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 123.2 | 168.2 | -80.9 | -84.5 | 0 | 0 | 0 | 109.1 | ||
| 4 | D | 56.5 | Low | 49.4 | Very low | 157 Ų | 157 | 147.3 Ų | 147.3 | 84% | 0.84 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 128.5 | 179.8 | -71.9 | -48 | 0 | 0 | 0 | 112.3 | ||
| 5 | T | 51.4 | Low | 49.1 | Very low | 136 Ų | 136 | 147 Ų | 147 | 83% | 0.834 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 123.6 | 169 | -59.5 | 0 | 0 | 0 | 0 | 109.1 | ||
| 6 | T | 56 | Low | 48.9 | Very low | 124 Ų | 124 | 147.5 Ų | 147.5 | 76% | 0.761 | 84% | 0.844 | S | S | * | * | trans | -108.5 | 114.1 | 162.9 | -59.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 7 | A | 44.9 | Very low | 48.7 | Very low | 82 Ų | 82 | 144.1 Ų | 144.1 | 68% | 0.678 | 84% | 0.838 | S | S | * | * | trans | -105.3 | 127.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 8 | N | 55 | Low | 49 | Very low | 154 Ų | 154 | 143.1 Ų | 143.1 | 82% | 0.824 | 84% | 0.835 | S | S | * | * | trans | -146 | 127.1 | 161.3 | -80.9 | -40.6 | 0 | 0 | 0 | 109.3 | ||||
| 9 | S | 49.2 | Very low | 48.9 | Very low | 118 Ų | 118 | 145.3 Ų | 145.3 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | trans | -62.9 | 166.1 | -168.2 | -55.1 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 10 | P | 46.8 | Very low | 49 | Very low | 130 Ų | 130 | 144 Ų | 144 | 84% | 0.844 | 83% | 0.831 | S | S | * | * | trans | -87.8 | 150.8 | -168.2 | 35.5 | -31 | 0 | 0 | 0 | 112.5 | ||||
| 11 | K | 49.1 | Very low | 49.5 | Very low | 202 Ų | 202 | 142.4 Ų | 142.4 | 88% | 0.878 | 83% | 0.828 | S | S | * | * | trans | -133.1 | 131 | 165.7 | -124.2 | 177.5 | -177.1 | 178.4 | 0 | 110.5 | ||||
| 12 | E | 46.3 | Very low | 50.1 | Low | 182 Ų | 182 | 138.2 Ų | 138.2 | 85% | 0.85 | 81% | 0.809 | S | S | * | * | trans | -43.1 | 152.8 | -179.2 | -63.6 | 158.4 | 132.9 | 0 | 0 | 115.9 | ||||
| 13 | S | 42.5 | Very low | 50.3 | Low | 129 Ų | 129 | 136 Ų | 136 | 90% | 0.902 | 80% | 0.803 | S | S | * | * | 139.5 | 119.9 | 117.9 | -172 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 14 | G | 40.2 | Very low | 50.1 | Low | 67 Ų | 67 | 132.4 Ų | 132.4 | 69% | 0.691 | 80% | 0.799 | S | S | * | * | trans | 135.8 | 54.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 15 | T | 45.5 | Very low | 50 | Low | 143 Ų | 143 | 133.5 Ų | 133.5 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | trans | -116.6 | 109.3 | 162.9 | -23.8 | 0 | 0 | 0 | 0 | 108.3 | A17 | T15-A17 PolarHBondContact O-N 3.24Å; T15-A17 VanDerWaalsContact O-N 3.11Å | ||
| 16 | N | 45.5 | Very low | 50.1 | Low | 155 Ų | 155 | 134.2 Ų | 134.2 | 83% | 0.829 | 79% | 0.793 | S | S | * | * | trans | -45.2 | 112.6 | 179.6 | -59.1 | -29.7 | 0 | 0 | 0 | 110.8 | T18 | N16-T18 PolarHBondContact O-N 3.11Å; N16-T18 VanDerWaalsContact O-N 3.13Å | ||
| 17 | A | 46 | Very low | 49.6 | Very low | 90 Ų | 90 | 133.5 Ų | 133.5 | 74% | 0.744 | 79% | 0.793 | S | S | * | * | trans | -69.4 | 106.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | T15 E19 | T15-A17 PolarHBondContact O-N 3.24Å; T15-A17 VanDerWaalsContact O-N 3.11Å; A17-E19 PolarHBondContact O-N 3.34Å | ||
| 18 | T | 53.4 | Low | 49.9 | Very low | 126 Ų | 126 | 139.9 Ų | 139.9 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -61.9 | 101.2 | 163.3 | -58.9 | 0 | 0 | 0 | 0 | 107.6 | N16 T20 | N16-T18 PolarHBondContact O-N 3.11Å; N16-T18 VanDerWaalsContact O-N 3.13Å; T18-T20 PolarHBondContact O-N 3.19Å; T18-T20 PolarHBondContact O-OG1 3.1Å | ||
| 19 | E | 47.9 | Very low | 49.6 | Very low | 185 Ų | 185 | 141.2 Ų | 141.2 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | trans | -58.5 | 99.2 | 173.3 | -67.4 | 179.7 | 158.6 | 0 | 0 | 109.3 | A17 S21 | A17-E19 PolarHBondContact O-N 3.34Å; E19-S21 PolarHBondContact O-N 2.87Å | ||
| 20 | T | 51.7 | Low | 49.7 | Very low | 119 Ų | 119 | 137.5 Ų | 137.5 | 73% | 0.73 | 79% | 0.786 | S | S | * | * | trans | -88.9 | 91.5 | 170.1 | -46.8 | 0 | 0 | 0 | 0 | 106.9 | T18 I22 | T18-T20 PolarHBondContact O-N 3.19Å; T18-T20 PolarHBondContact O-OG1 3.1Å; T20-I22 PolarHBondContact O-N 3.44Å | ||
| 21 | S | 58 | Low | 50 | Low | 110 Ų | 110 | 138.9 Ų | 138.9 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | trans | -62.2 | 103.8 | 173.7 | 169.1 | 0 | 0 | 0 | 0 | 109.9 | E19 | E19-S21 PolarHBondContact O-N 2.87Š| ||
| 22 | I | 55.3 | Low | 49.9 | Very low | 146 Ų | 146 | 136.1 Ų | 136.1 | 75% | 0.749 | 78% | 0.781 | S | S | * | * | trans | -75.4 | 121 | 168.3 | -56.9 | 176.4 | 0 | 0 | 0 | 107 | T20 S24 | T20-I22 PolarHBondContact O-N 3.44Å; I22-S24 PolarHBondContact O-N 2.95Å | ||
| 23 | P | 55.7 | Low | 50.4 | Low | 113 Ų | 113 | 132.9 Ų | 132.9 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -63.9 | 114.8 | 171.7 | -6.2 | 19.7 | 0 | 0 | 0 | 108 | H25 | P23-H25 PolarHBondContact O-N 3.35Š| ||
| 24 | S | 56 | Low | 51.4 | Low | 113 Ų | 113 | 133.8 Ų | 133.8 | 79% | 0.79 | 77% | 0.772 | S | S | * | * | trans | -61.2 | 102.8 | 167.2 | 51.7 | 0 | 0 | 0 | 0 | 107.8 | I22 E26 | I22-S24 PolarHBondContact O-N 2.95Å; S24-E26 PolarHBondContact O-N 3.28Å | ||
| 25 | H | 54.5 | Low | 52.5 | Low | 179 Ų | 179 | 141.5 Ų | 141.5 | 83% | 0.829 | 78% | 0.781 | S | S | * | * | trans | -65.8 | 100.1 | 175.6 | -175.4 | -73.1 | 0 | 0 | 0 | 108.3 | P23 S27 | P23-H25 PolarHBondContact O-N 3.35Å; H25-S27 PolarHBondContact O-N 3.26Å | ||
| 26 | E | 52.3 | Low | 53.3 | Low | 152 Ų | 152 | 139.9 Ų | 139.9 | 71% | 0.71 | 77% | 0.773 | S | S | * | * | trans | -47.7 | 120.7 | 171.9 | -165.1 | 178 | 164.8 | 0 | 0 | 109.4 | S24 R28 | S24-E26 PolarHBondContact O-N 3.28Å; E26-R28 PolarHBondContact O-N 3.2Å | ||
| 27 | S | 45 | Very low | 53.9 | Low | 109 Ų | 109 | 139.8 Ų | 139.8 | 76% | 0.762 | 76% | 0.762 | S | S | * | * | trans | -70.7 | 73.5 | 175.6 | 55.7 | 0 | 0 | 0 | 0 | 109.4 | H25 L29 | H25-S27 PolarHBondContact O-N 3.26Å; S27-L29 PolarHBondContact O-N 2.72Å | ||
| 28 | R | 51.9 | Low | 54.4 | Low | 216 Ų | 216 | 146 Ų | 146 | 82% | 0.815 | 77% | 0.766 | S | S | * | * | trans | -72.8 | 106.8 | 165 | -112.6 | -179.1 | 177.5 | -157 | -1.4 | 107.5 | E26 G30 | E26-R28 PolarHBondContact O-N 3.2Å; R28-G30 PolarHBondContact O-N 3.11Å | ||
| 29 | L | 48.5 | Very low | 54.7 | Low | 182 Ų | 182 | 144.8 Ų | 144.8 | 95% | 0.953 | 76% | 0.763 | S | S | * | * | trans | -55.4 | 82.7 | 162.6 | -77.1 | 154.8 | 0 | 0 | 0 | 108.5 | S27 | S27-L29 PolarHBondContact O-N 2.72Š| ||
| 30 | G | 51.7 | Low | 55.1 | Low | 40 Ų | 40 | 138.6 Ų | 138.6 | 41% | 0.412 | 75% | 0.748 | S | S | . | * | trans | -127.8 | 83.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | R28 N32 | R28-G30 PolarHBondContact O-N 3.11Å; G30-N32 PolarHBondContact O-N 3.25Å; G30-N32 PolarHBondContact O-OD1 3.39Å | ||
| 31 | N | 52.1 | Low | 55.3 | Low | 159 Ų | 159 | 138 Ų | 138 | 85% | 0.85 | 74% | 0.74 | S | S | * | * | trans | 51 | 56.1 | 150.7 | -29.4 | -8.9 | 0 | 0 | 0 | 114.2 | S33 | N31-S33 PolarHBondContact O-N 2.94Š| ||
| 32 | N | 47.5 | Very low | 55 | Low | 143 Ų | 143 | 139.1 Ų | 139.1 | 77% | 0.765 | 73% | 0.732 | S | S | * | * | trans | -70.8 | 72.5 | 176.7 | -73.2 | -10.6 | 0 | 0 | 0 | 111.4 | G30 L34 | G30-N32 PolarHBondContact O-N 3.25Å; G30-N32 PolarHBondContact O-OD1 3.39Å; N32-L34 PolarHBondContact O-N 3.46Å | ||
| 33 | S | 56.3 | Low | 55.1 | Low | 114 Ų | 114 | 138.1 Ų | 138.1 | 80% | 0.797 | 74% | 0.737 | S | S | * | * | trans | -75.2 | 82.5 | 153.9 | -175.2 | 0 | 0 | 0 | 0 | 107.1 | N31 R35 | N31-S33 PolarHBondContact O-N 2.94Å; S33-R35 PolarHBondContact O-N 3.12Å | ||
| 34 | L | 63.9 | Low | 55.1 | Low | 148 Ų | 148 | 142.7 Ų | 142.7 | 78% | 0.775 | 74% | 0.74 | S | S | * | * | trans | -63.2 | 108.1 | 166.1 | -70.5 | 173.6 | 0 | 0 | 0 | 106.6 | N32 | N32-L34 PolarHBondContact O-N 3.46Š| ||
| 35 | R | 63.8 | Low | 55.1 | Low | 229 Ų | 229 | 142.9 Ų | 142.9 | 86% | 0.864 | 74% | 0.737 | S | S | * | * | trans | -51.1 | 126.3 | 172.9 | -161.2 | 179.1 | -168.3 | -147.3 | 4.1 | 107.2 | S33 Y37 | S33-R35 PolarHBondContact O-N 3.12Å; R35-Y37 PolarHBondContact O-N 2.86Å | ||
| 36 | P | 62 | Low | 55.2 | Low | 110 Ų | 110 | 141.6 Ų | 141.6 | 71% | 0.714 | 73% | 0.733 | S | S | * | * | trans | -54.6 | 118.9 | 179.7 | -23.3 | 31.1 | 0 | 0 | 0 | 108.5 | R38 | P36-R38 PolarHBondContact O-N 3.39Š| ||
| 37 | Y | 58.6 | Low | 55.8 | Low | 152 Ų | 152 | 143.5 Ų | 143.5 | 60% | 0.596 | 74% | 0.739 | S | S | * | * | trans | -61.1 | 104.7 | 173.2 | -178.3 | -95.9 | 0 | 0 | 0 | 107.1 | R35 S39 F42 | R35-Y37 PolarHBondContact O-N 2.86Å; Y37-S39 VanDerWaalsContact C-N 3.34Å; Y37-S39 PolarHBondContact O-N 3.45Å; Y37-F42 HydrophobicContact CE1-CD2 4.04Å; Y37-F42 HydrophobicContact CE1-CE2 4.03Å; Y37-F42 HydrophobicContact CE2-CD2 4.49Å; Y37-F42 AromaticContact CE2-CE2 3.69Å; Y37-F42 HydrophobicContact CE2-CE2 3.69Å; Y37-F42 HydrophobicContact CE2-CZ 4.14Å; Y37-F42 AromaticContact CZ-CD2 3.65Å; Y37-F42 AromaticContact CZ-CE2 3.19Å; Y37-F42 AromaticContact CZ-CZ 3.73Å; Y37-F42 WeakPolarHBondContact OH-CD2 3.44Å; Y37-F42 WeakPolarHBondContact OH-CE1 3.45Å; Y37-F42 WeakPolarHBondContact OH-CE2 3.49Å; Y37-F42 WeakPolarHBondContact OH-CZ 3.3Å | ||
| 38 | R | 57.1 | Low | 56.8 | Low | 222 Ų | 222 | 148.9 Ų | 148.9 | 84% | 0.838 | 74% | 0.742 | S | S | * | * | trans | -66.3 | 98.1 | 173.7 | -82.3 | -108.5 | -179.8 | 176.3 | -1.4 | 106.9 | P36 G40 | P36-R38 PolarHBondContact O-N 3.39Å; R38-G40 PolarHBondContact O-N 3.16Å | ||
| 39 | S | 59.3 | Low | 57.4 | Low | 100 Ų | 100 | 148.6 Ų | 148.6 | 70% | 0.699 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | 24.7 | 173.4 | -56 | 0 | 0 | 0 | 0 | 114.2 | Y37 | Y37-S39 VanDerWaalsContact C-N 3.34Å; Y37-S39 PolarHBondContact O-N 3.45Å |
| 40 | G | 56.8 | Low | 58.3 | Low | 54 Ų | 54 | 143.9 Ų | 143.9 | 56% | 0.557 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | -16.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | R38 | R38-G40 PolarHBondContact O-N 3.16Š|
| 41 | D | 55.5 | Low | 59.1 | Low | 106 Ų | 106 | 146.8 Ų | 146.8 | 57% | 0.567 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -116.6 | -4.2 | -170.5 | -72.6 | -44.6 | 0 | 0 | 0 | 115.2 | S43 R44 | D41-S43 PolarHBondContact O-N 2.98Å; D41-R44 PolarHBondContact O-N 2.66Å |
| 42 | F | 52.1 | Low | 60.1 | Low | 135 Ų | 135 | 150.7 Ų | 150.7 | 59% | 0.592 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | -23.4 | 176.1 | -87.6 | -96.3 | 0 | 0 | 0 | 113 | Y37 R44 | Y37-F42 HydrophobicContact CE1-CD2 4.04Å; Y37-F42 HydrophobicContact CE1-CE2 4.03Å; Y37-F42 HydrophobicContact CE2-CD2 4.49Å; Y37-F42 AromaticContact CE2-CE2 3.69Å; Y37-F42 HydrophobicContact CE2-CE2 3.69Å; Y37-F42 HydrophobicContact CE2-CZ 4.14Å; Y37-F42 AromaticContact CZ-CD2 3.65Å; Y37-F42 AromaticContact CZ-CE2 3.19Å; Y37-F42 AromaticContact CZ-CZ 3.73Å; Y37-F42 WeakPolarHBondContact OH-CD2 3.44Å; Y37-F42 WeakPolarHBondContact OH-CE1 3.45Å; Y37-F42 WeakPolarHBondContact OH-CE2 3.49Å; Y37-F42 WeakPolarHBondContact OH-CZ 3.3Å; F42-R44 VanDerWaalsContact C-N 3.33Å |
| 43 | S | 55.7 | Low | 61.3 | Low | 124 Ų | 124 | 148.2 Ų | 148.2 | 87% | 0.867 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | -11.6 | 174.7 | -164.1 | 0 | 0 | 0 | 0 | 113.3 | D41 | D41-S43 PolarHBondContact O-N 2.98Š|
| 44 | R | 55.6 | Low | 62.4 | Low | 209 Ų | 209 | 146 Ų | 146 | 79% | 0.789 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.4 | -10 | -165.4 | -140.9 | 175.2 | -167.7 | -136.3 | 1.2 | 115.6 | D41 F42 | D41-R44 PolarHBondContact O-N 2.66Å; F42-R44 VanDerWaalsContact C-N 3.33Å |
| 45 | T | 56.3 | Low | 63.3 | Low | 118 Ų | 118 | 144.8 Ų | 144.8 | 72% | 0.724 | 71% | 0.712 | S | S | * | * | trans | -138.4 | 13.6 | -173.9 | 44.3 | 0 | 0 | 0 | 0 | 116.4 | K47 | T45-K47 PolarHBondContact O-N 3.27Š| ||
| 46 | M | 58.3 | Low | 64.2 | Low | 152 Ų | 152 | 141.4 Ų | 141.4 | 75% | 0.749 | 71% | 0.705 | S | S | * | * | trans | -79.9 | 63.2 | 165.9 | -150.9 | -175.7 | -56.2 | 0 | 0 | 110.7 | R48 | M46-R48 VanDerWaalsContact C-N 3.27Å; M46-R48 PolarHBondContact O-N 2.91Å | ||
| 47 | K | 63.5 | Low | 65.1 | Low | 192 Ų | 192 | 141.8 Ų | 141.8 | 84% | 0.835 | 70% | 0.696 | S | S | * | * | trans | -66.1 | 92.5 | 165.7 | -81.8 | -175.2 | 177.9 | 178.9 | 0 | 107.1 | T45 K49 | T45-K47 PolarHBondContact O-N 3.27Å; K47-K49 PolarHBondContact O-N 3.47Å | ||
| 48 | R | 65.7 | Low | 66.2 | Low | 221 Ų | 221 | 136 Ų | 136 | 83% | 0.834 | 68% | 0.679 | S | S | * | * | trans | -50.5 | 115.7 | 166 | -71.7 | -176 | 178.9 | 176.9 | -0.1 | 106.5 | M46 A50 | M46-R48 VanDerWaalsContact C-N 3.27Å; M46-R48 PolarHBondContact O-N 2.91Å; R48-A50 PolarHBondContact O-N 2.87Å | ||
| 49 | K | 66.3 | Low | 67.4 | Low | 211 Ų | 211 | 131.3 Ų | 131.3 | 92% | 0.917 | 67% | 0.665 | S | S | * | * | trans | -68.4 | 82.8 | 167.6 | -69.2 | -168.6 | -179.8 | -176.4 | 0 | 106.6 | K47 S51 | K47-K49 PolarHBondContact O-N 3.47Å; K49-S51 VanDerWaalsContact C-N 3.29Å; K49-S51 PolarHBondContact O-N 3.45Å | ||
| 50 | A | 66.9 | Low | 68.7 | Low | 83 Ų | 83 | 135.5 Ų | 135.5 | 69% | 0.686 | 67% | 0.665 | S | S | * | * | trans | -67.6 | 96.6 | 166.4 | 0 | 0 | 0 | 0 | 0 | 106.3 | R48 R52 | R48-A50 PolarHBondContact O-N 2.87Å; A50-R52 PolarHBondContact O-N 3.36Å | ||
| 51 | S | 68 | Low | 70 | Confident | 101 Ų | 101 | 137.7 Ų | 137.7 | 71% | 0.706 | 66% | 0.661 | S | S | * | * | trans | -64.1 | 104.1 | 170.8 | -175.2 | 0 | 0 | 0 | 0 | 107.2 | K49 I53 | K49-S51 VanDerWaalsContact C-N 3.29Å; K49-S51 PolarHBondContact O-N 3.45Å; S51-I53 VanDerWaalsContact C-N 3.26Å; S51-I53 PolarHBondContact O-N 3.46Å | ||
| 52 | R | 72.6 | Confident | 71.4 | Confident | 241 Ų | 241 | 138.7 Ų | 138.7 | 91% | 0.909 | 67% | 0.665 | S | S | * | * | trans | -71.5 | 88 | 172.6 | -70.3 | 176.5 | 67.7 | 118.7 | -1.8 | 107.4 | A50 S54 | A50-R52 PolarHBondContact O-N 3.36Å; R52-S54 PolarHBondContact O-N 3.17Å | ||
| 53 | I | 74 | Confident | 73 | Confident | 91 Ų | 91 | 142.9 Ų | 142.9 | 47% | 0.467 | 68% | 0.677 | S | S | . | * | trans | -67.1 | 127.2 | 170.4 | -60.5 | 170.4 | 0 | 0 | 0 | 107 | S51 K57 A58 | S51-I53 VanDerWaalsContact C-N 3.26Å; S51-I53 PolarHBondContact O-N 3.46Å; I53-K57 HydrophobicContact CG2-CB 4.08Å; I53-K57 HydrophobicContact CG2-CD 4.33Å; I53-K57 HydrophobicContact CG2-CG 4.28Å; I53-A58 HydrophobicContact CG2-CB 3.96Å | ||
| 54 | S | 78.6 | Confident | 74.6 | Confident | 67 Ų | 67 | 142.3 Ų | 142.3 | 47% | 0.469 | 67% | 0.665 | S | S | . | * | trans | -65.1 | 143.6 | 177.2 | 72.3 | 0 | 0 | 0 | 0 | 109.8 | R52 H56 K57 A58 | R52-S54 PolarHBondContact O-N 3.17Å; S54-H56 PolarHBondContact O-N 3Å; S54-K57 WeakPolarHBondContact O-CA 3.38Å; S54-K57 WeakPolarHBondContact O-CB 3.36Å; S54-K57 PolarHBondContact O-N 3.4Å; S54-K57 VanDerWaalsContact OG-CB 3.23Å; S54-K57 WeakPolarHBondContact OG-CB 3.31Å; S54-K57 PolarHBondContact OG-N 3.34Å; S54-A58 PolarHBondContact O-N 3.28Å | ||
| 55 | H | 82.1 | Confident | 76.1 | Confident | 123 Ų | 123 | 135.1 Ų | 135.1 | 57% | 0.569 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -56.1 | -37.3 | -179.4 | 179.4 | -117 | 0 | 0 | 0 | 112.6 | K59 | H55-K59 WeakPolarHBondContact CE1-CE 3.5Å; H55-K59 PolarHBondContact CE1-NZ 2.9Å; H55-K59 VanDerWaalsContact CE1-NZ 3.28Å; H55-K59 VanDerWaalsContact NE2-CE 3.31Å; H55-K59 WeakPolarHBondContact NE2-CE 3.35Å; H55-K59 WeakPolarHBondContact O-CB 3.43Å; H55-K59 WeakPolarHBondContact O-CG 3.49Å; H55-K59 PolarHBondContact O-N 3.48Å |
| 56 | H | 83.3 | Confident | 77.8 | Confident | 157 Ų | 157 | 134.7 Ų | 134.7 | 73% | 0.727 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -64.3 | -40.5 | 174.2 | -71.4 | -76.3 | 0 | 0 | 0 | 112.8 | S54 R60 | S54-H56 PolarHBondContact O-N 3Å; H56-R60 WeakPolarHBondContact O-CB 3.24Å; H56-R60 PolarHBondContact O-N 3.4Å; H56-R60 VanDerWaalsContact O-N 3.13Å |
| 57 | K | 81.1 | Confident | 79.4 | Confident | 118 Ų | 118 | 136.3 Ų | 136.3 | 51% | 0.513 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.3 | -46.1 | 177.1 | -171 | 178.8 | -176.3 | -162.7 | 0 | 110.8 | I53 S54 K59 R60 E61 | I53-K57 HydrophobicContact CG2-CB 4.08Å; I53-K57 HydrophobicContact CG2-CD 4.33Å; I53-K57 HydrophobicContact CG2-CG 4.28Å; S54-K57 WeakPolarHBondContact O-CA 3.38Å; S54-K57 WeakPolarHBondContact O-CB 3.36Å; S54-K57 PolarHBondContact O-N 3.4Å; S54-K57 VanDerWaalsContact OG-CB 3.23Å; S54-K57 WeakPolarHBondContact OG-CB 3.31Å; S54-K57 PolarHBondContact OG-N 3.34Å; K57-K59 PolarHBondContact O-N 3.45Å; K57-R60 PolarHBondContact O-N 3.5Å; K57-E61 WeakPolarHBondContact CE-OE1 3.38Å; K57-E61 IonicContact NZ-OE1 3.9Å; K57-E61 WeakPolarHBondContact O-CG 3.46Å; K57-E61 PolarHBondContact O-N 2.97Å |
| 58 | A | 81.2 | Confident | 80.7 | Confident | 30 Ų | 30 | 130.3 Ų | 130.3 | 25% | 0.248 | 63% | 0.626 | C | S | . | * | H | α-helix | trans | -59.1 | -47 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | I53 S54 R60 E61 I62 | I53-A58 HydrophobicContact CG2-CB 3.96Å; S54-A58 PolarHBondContact O-N 3.28Å; A58-R60 VanDerWaalsContact C-N 3.29Å; A58-R60 PolarHBondContact O-N 2.87Å; A58-E61 PolarHBondContact O-N 2.87Å; A58-I62 WeakPolarHBondContact O-CD1 3.49Å; A58-I62 VanDerWaalsContact O-CG1 3.26Å; A58-I62 WeakPolarHBondContact O-CG1 3.34Å; A58-I62 PolarHBondContact O-N 3.27Å |
| 59 | K | 83.1 | Confident | 82 | Confident | 124 Ų | 124 | 124.3 Ų | 124.3 | 54% | 0.539 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -58.1 | -40.5 | 176.1 | -81.5 | -175.2 | 163.7 | -177.3 | 0 | 112.8 | H55 K57 R63 | H55-K59 WeakPolarHBondContact CE1-CE 3.5Å; H55-K59 PolarHBondContact CE1-NZ 2.9Å; H55-K59 VanDerWaalsContact CE1-NZ 3.28Å; H55-K59 VanDerWaalsContact NE2-CE 3.31Å; H55-K59 WeakPolarHBondContact NE2-CE 3.35Å; H55-K59 WeakPolarHBondContact O-CB 3.43Å; H55-K59 WeakPolarHBondContact O-CG 3.49Å; H55-K59 PolarHBondContact O-N 3.48Å; K57-K59 PolarHBondContact O-N 3.45Å; K59-R63 WeakPolarHBondContact O-CB 3.26Å; K59-R63 PolarHBondContact O-N 3.08Å; K59-R63 VanDerWaalsContact O-N 3.11Å |
| 60 | R | 85.7 | Confident | 83.3 | Confident | 188 Ų | 188 | 116 Ų | 116 | 71% | 0.709 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -69 | -40.6 | 178.5 | -173.6 | 178.1 | 179.1 | -175.5 | -0.4 | 111.8 | H56 K57 A58 N64 | H56-R60 WeakPolarHBondContact O-CB 3.24Å; H56-R60 PolarHBondContact O-N 3.4Å; H56-R60 VanDerWaalsContact O-N 3.13Å; K57-R60 PolarHBondContact O-N 3.5Å; A58-R60 VanDerWaalsContact C-N 3.29Å; A58-R60 PolarHBondContact O-N 2.87Å; R60-N64 PolarHBondContact O-N 3.43Å; R60-N64 PolarHBondContact O-ND2 2.94Å; R60-N64 VanDerWaalsContact O-ND2 3.13Å |
| 61 | E | 84.3 | Confident | 84.5 | Confident | 100 Ų | 100 | 114.5 Ų | 114.5 | 47% | 0.467 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.6 | -45.3 | 176.6 | -73.9 | 174.7 | -174.7 | 0 | 0 | 111.3 | K57 A58 R63 N64 A65 | K57-E61 WeakPolarHBondContact CE-OE1 3.38Å; K57-E61 IonicContact NZ-OE1 3.9Å; K57-E61 WeakPolarHBondContact O-CG 3.46Å; K57-E61 PolarHBondContact O-N 2.97Å; A58-E61 PolarHBondContact O-N 2.87Å; E61-R63 PolarHBondContact O-N 3.35Å; E61-N64 CarbonylContact O-C 3.59Å; E61-N64 PolarHBondContact O-N 3.28Å; E61-A65 PolarHBondContact O-N 3.47Å |
| 62 | I | 85.6 | Confident | 85.7 | Confident | 128 Ų | 128 | 113.7 Ų | 113.7 | 66% | 0.656 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.6 | -43.9 | 178.2 | -65.6 | 162.7 | 0 | 0 | 0 | 111.4 | A58 N64 A65 | A58-I62 WeakPolarHBondContact O-CD1 3.49Å; A58-I62 VanDerWaalsContact O-CG1 3.26Å; A58-I62 WeakPolarHBondContact O-CG1 3.34Å; A58-I62 PolarHBondContact O-N 3.27Å; I62-N64 PolarHBondContact O-N 3.4Å; I62-A65 PolarHBondContact O-N 2.9Å |
| 63 | R | 86.1 | Confident | 86.7 | Confident | 222 Ų | 222 | 109.9 Ų | 109.9 | 84% | 0.838 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.3 | -26.2 | -179.3 | -172.5 | 176.5 | 178.9 | -166.8 | -0.2 | 113.2 | K59 E61 | K59-R63 WeakPolarHBondContact O-CB 3.26Å; K59-R63 PolarHBondContact O-N 3.08Å; K59-R63 VanDerWaalsContact O-N 3.11Å; E61-R63 PolarHBondContact O-N 3.35Å |
| 64 | N | 88.2 | Confident | 87.6 | Confident | 113 Ų | 113 | 111 Ų | 111 | 60% | 0.604 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.9 | 3.1 | -177 | -61.1 | -27.5 | 0 | 0 | 0 | 112.7 | R60 E61 I62 | R60-N64 PolarHBondContact O-N 3.43Å; R60-N64 PolarHBondContact O-ND2 2.94Å; R60-N64 VanDerWaalsContact O-ND2 3.13Å; E61-N64 CarbonylContact O-C 3.59Å; E61-N64 PolarHBondContact O-N 3.28Å; I62-N64 PolarHBondContact O-N 3.4Å |
| 65 | A | 87.8 | Confident | 88.3 | Confident | 57 Ų | 57 | 111.9 Ų | 111.9 | 47% | 0.471 | 55% | 0.551 | S | S | . | * | S | Bend | trans | -66.5 | 136.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | E61 I62 | E61-A65 PolarHBondContact O-N 3.47Å; I62-A65 PolarHBondContact O-N 2.9Å |
| 66 | P | 91.6 | Very high | 88.9 | Confident | 110 Ų | 110 | 110.9 Ų | 110.9 | 71% | 0.714 | 55% | 0.548 | S | S | * | . | P | Polyproline II helix | trans | -65.2 | 143 | 174.1 | 28.6 | -33.5 | 0 | 0 | 0 | 109.6 | T68 | P66-T68 PolarHBondContact O-N 3.14Š|
| 67 | W | 91.4 | Very high | 89.4 | Confident | 185 Ų | 185 | 108.1 Ų | 108.1 | 70% | 0.701 | 54% | 0.539 | S | S | * | . | P | Polyproline II helix | trans | -61.9 | 130.8 | 169.7 | -79.2 | 82.8 | 0 | 0 | 0 | 109.5 | D71 | W67-D71 HydrophobicContact CD2-CB 4.4Å; W67-D71 HydrophobicContact CE3-CB 3.35Å; W67-D71 HydrophobicContact CZ3-CB 3.52Å |
| 68 | T | 91.7 | Very high | 90 | Very high | 66 Ų | 66 | 105.2 Ų | 105.2 | 41% | 0.405 | 53% | 0.533 | S | S | . | . | P | Polyproline II helix | trans | -101.8 | 154.7 | 172.9 | 70 | 0 | 0 | 0 | 0 | 109.4 | P66 G70 D71 | P66-T68 PolarHBondContact O-N 3.14Å; T68-G70 PolarHBondContact O-N 2.91Å; T68-G70 VanDerWaalsContact O-N 3.08Å; T68-D71 WeakPolarHBondContact CA-OD2 3.37Å; T68-D71 WeakPolarHBondContact CB-OD2 3.47Å; T68-D71 PolarHBondContact N-OD2 2.93Å; T68-D71 WeakPolarHBondContact O-CB 3.04Å; T68-D71 PolarHBondContact O-N 3.4Å; T68-D71 VanDerWaalsContact OG1-CG 3.25Å; T68-D71 PolarHBondContact OG1-N 2.76Å; T68-D71 PolarHBondContact OG1-OD2 2.85Å |
| 69 | P | 93 | Very high | 90.7 | Very high | 95 Ų | 95 | 107.9 Ų | 107.9 | 62% | 0.617 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -56 | -27.5 | 172.9 | -26.6 | 35.1 | 0 | 0 | 0 | 113.1 | D71 D72 Y73 | P69-D71 VanDerWaalsContact C-N 3.26Å; P69-D71 PolarHBondContact O-N 2.72Å; P69-D72 WeakPolarHBondContact O-CB 3.23Å; P69-D72 PolarHBondContact O-N 3.04Å; P69-Y73 WeakPolarHBondContact O-CD2 3.43Å; P69-Y73 PolarHBondContact O-N 3.39Å |
| 70 | G | 92.8 | Very high | 91.3 | Very high | 36 Ų | 36 | 105.8 Ų | 105.8 | 37% | 0.371 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -59.1 | -35.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | T68 D72 Y73 L74 | T68-G70 PolarHBondContact O-N 2.91Å; T68-G70 VanDerWaalsContact O-N 3.08Å; G70-D72 VanDerWaalsContact C-N 3.34Å; G70-Y73 PolarHBondContact O-N 3.22Å; G70-L74 WeakPolarHBondContact O-CG 3.46Å; G70-L74 PolarHBondContact O-N 3.3Å; G70-L74 VanDerWaalsContact O-N 3.14Å |
| 71 | D | 93.3 | Very high | 91.7 | Very high | 52 Ų | 52 | 102.5 Ų | 102.5 | 28% | 0.278 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -70.4 | -32.1 | -179.9 | -57.7 | -49.9 | 0 | 0 | 0 | 111.6 | W67 T68 P69 L74 L75 | W67-D71 HydrophobicContact CD2-CB 4.4Å; W67-D71 HydrophobicContact CE3-CB 3.35Å; W67-D71 HydrophobicContact CZ3-CB 3.52Å; T68-D71 WeakPolarHBondContact CA-OD2 3.37Å; T68-D71 WeakPolarHBondContact CB-OD2 3.47Å; T68-D71 PolarHBondContact N-OD2 2.93Å; T68-D71 WeakPolarHBondContact O-CB 3.04Å; T68-D71 PolarHBondContact O-N 3.4Å; T68-D71 VanDerWaalsContact OG1-CG 3.25Å; T68-D71 PolarHBondContact OG1-N 2.76Å; T68-D71 PolarHBondContact OG1-OD2 2.85Å; P69-D71 VanDerWaalsContact C-N 3.26Å; P69-D71 PolarHBondContact O-N 2.72Å; D71-L74 PolarHBondContact O-N 3.11Å; D71-L75 WeakPolarHBondContact O-CB 3.35Å; D71-L75 PolarHBondContact O-N 3.13Å |
| 72 | D | 92.3 | Very high | 92.2 | Very high | 85 Ų | 85 | 102.5 Ų | 102.5 | 46% | 0.455 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 173.5 | -67.3 | -28.9 | 0 | 0 | 0 | 111.3 | P69 G70 L74 L75 I76 | P69-D72 WeakPolarHBondContact O-CB 3.23Å; P69-D72 PolarHBondContact O-N 3.04Å; G70-D72 VanDerWaalsContact C-N 3.34Å; D72-L74 VanDerWaalsContact C-N 3.33Å; D72-L74 PolarHBondContact O-N 3.26Å; D72-L75 PolarHBondContact O-N 3.23Å; D72-I76 WeakPolarHBondContact O-CB 3.37Å; D72-I76 WeakPolarHBondContact O-CD1 3.46Å; D72-I76 VanDerWaalsContact O-CG1 3.24Å; D72-I76 WeakPolarHBondContact O-CG1 3.43Å; D72-I76 PolarHBondContact O-N 2.94Å |
| 73 | Y | 93.5 | Very high | 92.6 | Very high | 161 Ų | 161 | 99.6 Ų | 99.6 | 63% | 0.631 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.7 | -42.6 | 174.6 | -68.4 | -75 | 0 | 0 | 0 | 111.5 | P69 G70 N77 | P69-Y73 WeakPolarHBondContact O-CD2 3.43Å; P69-Y73 PolarHBondContact O-N 3.39Å; G70-Y73 PolarHBondContact O-N 3.22Å; Y73-N77 VanDerWaalsContact O-CB 3.23Å; Y73-N77 WeakPolarHBondContact O-CB 3.22Å; Y73-N77 PolarHBondContact O-N 3.13Å; Y73-N77 PolarHBondContact O-ND2 3.28Å |
| 74 | L | 93.1 | Very high | 93 | Very high | 113 Ų | 113 | 92.1 Ų | 92.1 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.9 | -41.4 | 176.2 | -67.8 | 176 | 0 | 0 | 0 | 111.6 | G70 D71 D72 S78 | G70-L74 WeakPolarHBondContact O-CG 3.46Å; G70-L74 PolarHBondContact O-N 3.3Å; G70-L74 VanDerWaalsContact O-N 3.14Å; D71-L74 PolarHBondContact O-N 3.11Å; D72-L74 VanDerWaalsContact C-N 3.33Å; D72-L74 PolarHBondContact O-N 3.26Å; L74-S78 WeakPolarHBondContact O-CB 3.33Å; L74-S78 PolarHBondContact O-N 3.45Å |
| 75 | L | 94.1 | Very high | 93.3 | Very high | 87 Ų | 87 | 91 Ų | 91 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.5 | -50.7 | 177.6 | -177.9 | 62.6 | 0 | 0 | 0 | 111.1 | D71 D72 N77 S78 V79 | D71-L75 WeakPolarHBondContact O-CB 3.35Å; D71-L75 PolarHBondContact O-N 3.13Å; D72-L75 PolarHBondContact O-N 3.23Å; L75-N77 PolarHBondContact O-N 2.93Å; L75-S78 PolarHBondContact O-N 3.23Å; L75-S78 VanDerWaalsContact O-N 3.16Å; L75-S78 PolarHBondContact O-OG 2.94Å; L75-V79 WeakPolarHBondContact O-CG2 3.49Å; L75-V79 PolarHBondContact O-N 3.47Å |
| 76 | I | 94.3 | Very high | 93.7 | Very high | 102 Ų | 102 | 94.6 Ų | 94.6 | 52% | 0.523 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60 | -47.2 | 178.3 | -67.1 | 163.5 | 0 | 0 | 0 | 110.5 | D72 S78 V79 V80 | D72-I76 WeakPolarHBondContact O-CB 3.37Å; D72-I76 WeakPolarHBondContact O-CD1 3.46Å; D72-I76 VanDerWaalsContact O-CG1 3.24Å; D72-I76 WeakPolarHBondContact O-CG1 3.43Å; D72-I76 PolarHBondContact O-N 2.94Å; I76-S78 VanDerWaalsContact C-N 3.27Å; I76-S78 PolarHBondContact O-N 3.34Å; I76-V79 PolarHBondContact O-N 2.92Å; I76-V79 VanDerWaalsContact O-N 3.17Å; I76-V80 HydrophobicContact CG2-CG2 4.33Å; I76-V80 WeakPolarHBondContact O-CG2 3.49Å; I76-V80 PolarHBondContact O-N 3.24Å |
| 77 | N | 93.8 | Very high | 93.7 | Very high | 98 Ų | 98 | 92.2 Ų | 92.2 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.3 | -41.8 | 176.8 | -73.8 | -14.6 | 0 | 0 | 0 | 111.4 | Y73 L75 V80 M81 | Y73-N77 VanDerWaalsContact O-CB 3.23Å; Y73-N77 WeakPolarHBondContact O-CB 3.22Å; Y73-N77 PolarHBondContact O-N 3.13Å; Y73-N77 PolarHBondContact O-ND2 3.28Å; L75-N77 PolarHBondContact O-N 2.93Å; N77-V80 PolarHBondContact O-N 2.99Å; N77-M81 WeakPolarHBondContact O-CB 3.5Å; N77-M81 VanDerWaalsContact O-CG 3.22Å; N77-M81 WeakPolarHBondContact O-CG 3.26Å; N77-M81 PolarHBondContact O-N 3.42Å |
| 78 | S | 94.1 | Very high | 93.9 | Very high | 57 Ų | 57 | 90.9 Ų | 90.9 | 40% | 0.399 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 177.6 | 77.8 | 0 | 0 | 0 | 0 | 112.3 | L74 L75 I76 M81 V82 | L74-S78 WeakPolarHBondContact O-CB 3.33Å; L74-S78 PolarHBondContact O-N 3.45Å; L75-S78 PolarHBondContact O-N 3.23Å; L75-S78 VanDerWaalsContact O-N 3.16Å; L75-S78 PolarHBondContact O-OG 2.94Å; I76-S78 VanDerWaalsContact C-N 3.27Å; I76-S78 PolarHBondContact O-N 3.34Å; S78-M81 PolarHBondContact O-N 3.11Å; S78-V82 WeakPolarHBondContact O-CG2 3.41Å; S78-V82 PolarHBondContact O-N 3.13Å |
| 79 | V | 95.2 | Very high | 94 | Very high | 87 Ų | 87 | 92 Ų | 92 | 53% | 0.527 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.4 | -44.1 | 177.9 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | L75 I76 M81 V82 S83 | L75-V79 WeakPolarHBondContact O-CG2 3.49Å; L75-V79 PolarHBondContact O-N 3.47Å; I76-V79 PolarHBondContact O-N 2.92Å; I76-V79 VanDerWaalsContact O-N 3.17Å; V79-M81 VanDerWaalsContact C-N 3.33Å; V79-M81 PolarHBondContact O-N 3.19Å; V79-V82 PolarHBondContact O-N 2.95Å; V79-S83 VanDerWaalsContact O-CB 3.3Å; V79-S83 WeakPolarHBondContact O-CB 3.16Å; V79-S83 PolarHBondContact O-N 3.19Å |
| 80 | V | 95.1 | Very high | 94.1 | Very high | 80 Ų | 80 | 96 Ų | 96 | 49% | 0.485 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.4 | -42.9 | 176.6 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | I76 N77 S83 S84 | I76-V80 HydrophobicContact CG2-CG2 4.33Å; I76-V80 WeakPolarHBondContact O-CG2 3.49Å; I76-V80 PolarHBondContact O-N 3.24Å; N77-V80 PolarHBondContact O-N 2.99Å; V80-S83 PolarHBondContact O-N 3.07Å; V80-S84 VanDerWaalsContact O-CB 3.31Å; V80-S84 WeakPolarHBondContact O-CB 3.47Å; V80-S84 PolarHBondContact O-N 3Å; V80-S84 PolarHBondContact O-OG 2.92Å |
| 81 | M | 94.9 | Very high | 94 | Very high | 119 Ų | 119 | 101.2 Ų | 101.2 | 59% | 0.586 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62 | -48.7 | 176.7 | -74.7 | -64.7 | -63.6 | 0 | 0 | 111.8 | N77 S78 V79 S83 S84 I85 | N77-M81 WeakPolarHBondContact O-CB 3.5Å; N77-M81 VanDerWaalsContact O-CG 3.22Å; N77-M81 WeakPolarHBondContact O-CG 3.26Å; N77-M81 PolarHBondContact O-N 3.42Å; S78-M81 PolarHBondContact O-N 3.11Å; V79-M81 VanDerWaalsContact C-N 3.33Å; V79-M81 PolarHBondContact O-N 3.19Å; M81-S83 PolarHBondContact O-N 2.95Å; M81-S84 PolarHBondContact O-N 3.06Å; M81-I85 WeakPolarHBondContact O-CD1 3.42Å; M81-I85 VanDerWaalsContact O-CG1 3.26Å; M81-I85 WeakPolarHBondContact O-CG1 3.15Å; M81-I85 PolarHBondContact O-N 2.92Å |
| 82 | V | 94.7 | Very high | 93.9 | Very high | 100 Ų | 100 | 103.7 Ų | 103.7 | 61% | 0.606 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.6 | -43.1 | 178.5 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | S78 V79 S84 I85 F86 | S78-V82 WeakPolarHBondContact O-CG2 3.41Å; S78-V82 PolarHBondContact O-N 3.13Å; V79-V82 PolarHBondContact O-N 2.95Å; V82-S84 PolarHBondContact O-N 2.87Å; V82-I85 PolarHBondContact O-N 3.41Å; V82-F86 WeakPolarHBondContact O-CB 3.23Å; V82-F86 PolarHBondContact O-N 3.31Å |
| 83 | S | 94.4 | Very high | 93.7 | Very high | 66 Ų | 66 | 105.4 Ų | 105.4 | 46% | 0.462 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 176.4 | -178.7 | 0 | 0 | 0 | 0 | 111.7 | V79 V80 M81 F86 C87 | V79-S83 VanDerWaalsContact O-CB 3.3Å; V79-S83 WeakPolarHBondContact O-CB 3.16Å; V79-S83 PolarHBondContact O-N 3.19Å; V80-S83 PolarHBondContact O-N 3.07Å; M81-S83 PolarHBondContact O-N 2.95Å; S83-F86 PolarHBondContact O-N 2.92Å; S83-C87 WeakPolarHBondContact O-CB 2.74Å; S83-C87 PolarHBondContact O-N 3.21Å; S83-C87 PolarHBondContact O-SG 3.36Å; S83-C87 VanDerWaalsContact O-SG 3.34Å |
| 84 | S | 94.4 | Very high | 92.5 | Very high | 65 Ų | 65 | 103.4 Ų | 103.4 | 46% | 0.455 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.4 | -44.2 | 177.9 | -58.8 | 0 | 0 | 0 | 0 | 111.8 | V80 M81 V82 C87 W88 | V80-S84 VanDerWaalsContact O-CB 3.31Å; V80-S84 WeakPolarHBondContact O-CB 3.47Å; V80-S84 PolarHBondContact O-N 3Å; V80-S84 PolarHBondContact O-OG 2.92Å; M81-S84 PolarHBondContact O-N 3.06Å; V82-S84 PolarHBondContact O-N 2.87Å; S84-C87 PolarHBondContact O-N 2.79Å; S84-W88 WeakPolarHBondContact O-CB 3.5Å; S84-W88 PolarHBondContact O-N 3.18Å |
| 85 | I | 94.9 | Very high | 92.4 | Very high | 91 Ų | 91 | 103 Ų | 103 | 47% | 0.467 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.2 | -44.5 | 175.5 | -68.1 | 163.1 | 0 | 0 | 0 | 110.4 | M81 V82 W88 L89 | M81-I85 WeakPolarHBondContact O-CD1 3.42Å; M81-I85 VanDerWaalsContact O-CG1 3.26Å; M81-I85 WeakPolarHBondContact O-CG1 3.15Å; M81-I85 PolarHBondContact O-N 2.92Å; V82-I85 PolarHBondContact O-N 3.41Å; I85-W88 PolarHBondContact O-N 3.19Å; I85-L89 HydrophobicContact CG2-CD1 3.93Å; I85-L89 HydrophobicContact CG2-CG 4.37Å; I85-L89 WeakPolarHBondContact O-CB 3.5Å; I85-L89 WeakPolarHBondContact O-CG 3.31Å; I85-L89 PolarHBondContact O-N 2.96Å |
| 86 | F | 94.4 | Very high | 92.4 | Very high | 131 Ų | 131 | 103.8 Ų | 103.8 | 58% | 0.575 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -62.6 | -43.8 | 178 | -178.4 | -97.5 | 0 | 0 | 0 | 112.1 | V82 S83 W88 L89 R90 | V82-F86 WeakPolarHBondContact O-CB 3.23Å; V82-F86 PolarHBondContact O-N 3.31Å; S83-F86 PolarHBondContact O-N 2.92Å; F86-W88 VanDerWaalsContact C-N 3.31Å; F86-W88 PolarHBondContact O-N 2.76Å; F86-L89 PolarHBondContact O-N 2.99Å; F86-R90 WeakPolarHBondContact O-CB 2.88Å; F86-R90 PolarHBondContact O-N 2.89Å |
| 87 | C | 93.2 | Very high | 92.3 | Very high | 61 Ų | 61 | 103.9 Ų | 103.9 | 41% | 0.412 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.6 | -37.5 | 174.8 | -74.5 | 0 | 0 | 0 | 0 | 112.5 | S83 S84 Q91 | S83-C87 WeakPolarHBondContact O-CB 2.74Å; S83-C87 PolarHBondContact O-N 3.21Å; S83-C87 PolarHBondContact O-SG 3.36Å; S83-C87 VanDerWaalsContact O-SG 3.34Å; S84-C87 PolarHBondContact O-N 2.79Å; C87-Q91 WeakPolarHBondContact O-CG 3.18Å; C87-Q91 PolarHBondContact O-N 2.8Å; C87-Q91 PolarHBondContact O-NE2 3.06Å; C87-Q91 VanDerWaalsContact O-NE2 3.11Å |
| 88 | W | 94.4 | Very high | 92.2 | Very high | 157 Ų | 157 | 104.2 Ų | 104.2 | 60% | 0.595 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -70.1 | -45.4 | 176.9 | -171.7 | 77 | 0 | 0 | 0 | 111.9 | S84 I85 F86 R90 Q91 L92 | S84-W88 WeakPolarHBondContact O-CB 3.5Å; S84-W88 PolarHBondContact O-N 3.18Å; I85-W88 PolarHBondContact O-N 3.19Å; F86-W88 VanDerWaalsContact C-N 3.31Å; F86-W88 PolarHBondContact O-N 2.76Å; W88-R90 VanDerWaalsContact C-N 3.31Å; W88-R90 PolarHBondContact O-N 3.48Å; W88-Q91 WeakPolarHBondContact O-CB 3.45Å; W88-Q91 PolarHBondContact O-N 2.92Å; W88-Q91 VanDerWaalsContact O-N 3.12Å; W88-L92 HydrophobicContact CD2-CD1 3.98Å; W88-L92 HydrophobicContact CE3-CD1 3.64Å; W88-L92 HydrophobicContact CH2-CD1 3.41Å; W88-L92 VanDerWaalsContact CH2-CD1 3.41Å; W88-L92 HydrophobicContact CZ2-CD1 3.73Å; W88-L92 HydrophobicContact CZ2-CG 4.48Å; W88-L92 HydrophobicContact CZ3-CD1 3.34Å; W88-L92 PolarHBondContact O-N 3.03Å |
| 89 | L | 94.8 | Very high | 92 | Very high | 88 Ų | 88 | 107.2 Ų | 107.2 | 46% | 0.461 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -58.7 | -42.7 | 174.6 | -74.9 | 170.8 | 0 | 0 | 0 | 111.8 | I85 F86 Q91 L92 T93 | I85-L89 HydrophobicContact CG2-CD1 3.93Å; I85-L89 HydrophobicContact CG2-CG 4.37Å; I85-L89 WeakPolarHBondContact O-CB 3.5Å; I85-L89 WeakPolarHBondContact O-CG 3.31Å; I85-L89 PolarHBondContact O-N 2.96Å; F86-L89 PolarHBondContact O-N 2.99Å; L89-Q91 VanDerWaalsContact C-N 3.27Å; L89-Q91 PolarHBondContact O-N 2.76Å; L89-L92 PolarHBondContact O-N 2.92Å; L89-L92 VanDerWaalsContact O-N 3.1Å; L89-T93 PolarHBondContact O-N 2.99Å; L89-T93 VanDerWaalsContact O-N 3.11Å; L89-T93 PolarHBondContact O-OG1 2.79Å |
| 90 | R | 93.7 | Very high | 91.8 | Very high | 179 Ų | 179 | 108.5 Ų | 108.5 | 68% | 0.675 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -62.4 | -33 | 177.1 | -173.8 | -179.5 | 170.7 | 113.1 | 1.5 | 112.9 | F86 W88 L92 G94 | F86-R90 WeakPolarHBondContact O-CB 2.88Å; F86-R90 PolarHBondContact O-N 2.89Å; W88-R90 VanDerWaalsContact C-N 3.31Å; W88-R90 PolarHBondContact O-N 3.48Å; R90-L92 VanDerWaalsContact C-N 3.34Å; R90-G94 PolarHBondContact O-N 3.22Å |
| 91 | Q | 91.7 | Very high | 91.6 | Very high | 147 Ų | 147 | 110.6 Ų | 110.6 | 69% | 0.687 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -73.1 | -25.5 | 175.2 | -76.9 | 171.4 | 78.6 | 0 | 0 | 112.9 | C87 W88 L89 | C87-Q91 WeakPolarHBondContact O-CG 3.18Å; C87-Q91 PolarHBondContact O-N 2.8Å; C87-Q91 PolarHBondContact O-NE2 3.06Å; C87-Q91 VanDerWaalsContact O-NE2 3.11Å; W88-Q91 WeakPolarHBondContact O-CB 3.45Å; W88-Q91 PolarHBondContact O-N 2.92Å; W88-Q91 VanDerWaalsContact O-N 3.12Å; L89-Q91 VanDerWaalsContact C-N 3.27Å; L89-Q91 PolarHBondContact O-N 2.76Å |
| 92 | L | 90.8 | Very high | 91.3 | Very high | 104 Ų | 104 | 109.9 Ų | 109.9 | 55% | 0.545 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -83.1 | -27.1 | 177.1 | -70.7 | 176.5 | 0 | 0 | 0 | 113.7 | W88 L89 R90 | W88-L92 HydrophobicContact CD2-CD1 3.98Å; W88-L92 HydrophobicContact CE3-CD1 3.64Å; W88-L92 HydrophobicContact CH2-CD1 3.41Å; W88-L92 VanDerWaalsContact CH2-CD1 3.41Å; W88-L92 HydrophobicContact CZ2-CD1 3.73Å; W88-L92 HydrophobicContact CZ2-CG 4.48Å; W88-L92 HydrophobicContact CZ3-CD1 3.34Å; W88-L92 PolarHBondContact O-N 3.03Å; L89-L92 PolarHBondContact O-N 2.92Å; L89-L92 VanDerWaalsContact O-N 3.1Å; R90-L92 VanDerWaalsContact C-N 3.34Å |
| 93 | T | 88.6 | Confident | 91.1 | Very high | 120 Ų | 120 | 110.8 Ų | 110.8 | 74% | 0.736 | 61% | 0.609 | S | S | * | * | trans | -101.8 | 0.3 | -178.9 | 63.9 | 0 | 0 | 0 | 0 | 113.6 | L89 | L89-T93 PolarHBondContact O-N 2.99Å; L89-T93 VanDerWaalsContact O-N 3.11Å; L89-T93 PolarHBondContact O-OG1 2.79Å | ||
| 94 | G | 67.5 | Low | 90.8 | Very high | 120 Ų | 120 | 114.8 Ų | 114.8 | 100% | 1.237 | 62% | 0.622 | S | S | * | * | trans | -99.2 | 0 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R90 | R90-G94 PolarHBondContact O-N 3.22Š|
Retrieved 94 of 94 residues in 14.6 ms
(Link to these results)